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Information card for entry 7160654
Preview
| Coordinates | 7160654.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19 H12 O3 |
|---|---|
| Calculated formula | C19 H12 O3 |
| Title of publication | NaIO₄–Driven Oxidative Dimerization and Cu(I)-Catalyzed Oxidative Decarbonylation: Modular Synthesis of 1,2-Naphthoquinones and Aryl Naphtho[2,b]furans |
| Authors of publication | Lone, Mudassir Ahmad; Rather, Gowhar Ahmad; Tarray, Amir Rashid; Lone, Waseem Iqbal; Rashid, Showkat |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 16.883 ± 0.0006 Å |
| b | 7.0571 ± 0.0002 Å |
| c | 24.4179 ± 0.0008 Å |
| α | 90° |
| β | 94.618 ± 0.001° |
| γ | 90° |
| Cell volume | 2899.83 ± 0.16 Å3 |
| Cell temperature | 273.15 K |
| Ambient diffraction temperature | 273.15 K |
| Number of distinct elements | 3 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0731 |
| Residual factor for significantly intense reflections | 0.0483 |
| Weighted residual factors for significantly intense reflections | 0.1064 |
| Weighted residual factors for all reflections included in the refinement | 0.1228 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301464 (current) | 2025-08-05 | cif/ Adding structures of 7160654 via cif-deposit CGI script. |
7160654.cif |
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